Home Other Building Blocks 2-(4-hydroxy-2-(trifluoromethyl)phenyl)acetic acid

2-(4-hydroxy-2-(trifluoromethyl)phenyl)acetic acid

CAS No.:
1261569-12-3
Catalog Number:
AG01BTI1
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
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Product Description
Catalog Number:
AG01BTI1
Chemical Name:
2-(4-hydroxy-2-(trifluoromethyl)phenyl)acetic acid
CAS Number:
1261569-12-3
Molecular Formula:
C9H7F3O3
Molecular Weight:
220.1453
MDL Number:
MFCD18397679
IUPAC Name:
2-[4-hydroxy-2-(trifluoromethyl)phenyl]acetic acid
InChI:
InChI=1S/C9H7F3O3/c10-9(11,12)7-4-6(13)2-1-5(7)3-8(14)15/h1-2,4,13H,3H2,(H,14,15)
InChI Key:
PQKOWGLTNBRLRP-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1C(F)(F)F)O
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.147g/mol
Monoisotopic Mass:
220.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties